反-3-己烯酸，CAS 登记号 1577-18-0，由济南圣和化工有限公司现货供应，可提供纯度 按批次COA提供(不公开发布) 的规格，下游主要用于食用香精。支持样品与小批量试用，批量价格请联系我们获取，验收以批次 COA 为准。
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本页已列出 反-3-己烯酸 的 CAS 号：1577-18-0，可与随货 COA 核对。
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3-Hexenoic acid is identified by CAS 1577-18-0, molecular formula C6H10O2 and molecular weight 114.07 g/mol. UNII 9B3N069EDG; ChEBI 49285; InChIKey XXHDAWYDNSXJQM-ONEGZZNKSA-N.
| CAS Registry Number | 1577-18-0 |
|---|---|
| PubChem CID | 5282708 |
| Molecular formula | C6H10O2 |
| Molecular weight | 114.07 g/mol |
| IUPAC name | (E)-hex-3-enoic acid |
| InChIKey | XXHDAWYDNSXJQM-ONEGZZNKSA-N |
| UNII (FDA) | 9B3N069EDG |
| ChEBI ID | CHEBI:49285 |
| FEMA number | 3170 |
| JECFA number | 317 |
| Molecular Weight | 114.14 |
|---|---|
| XLogP3 | 1.2 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 3 |
| Exact Mass | 114.068079557 |
| Monoisotopic Mass | 114.068079557 |
| Topological Polar Surface Area | 37.3 |
| Heavy Atom Count | 8 |
| Formal Charge | 0 |
| Regulatory & Food Contact | FDA Substance added to food: FLAVORING AGENT OR ADJUVANT FLAVOURING_AGENT: Flavouring Agent Fruit No safety concern at current levels of intake when used as a flavouring agent TRS 891-JECFA 51/68 FAS 42-JECFA 51/267 |
|---|---|
| GHS notification summary | 0.1% (2 / 1372) |
| GHS notification summary | 0.1% (2 / 1372) |
|---|---|
| Reported hazard statements | H314 (99.9%) |
This chemical does not meet GHS hazard criteria for 0.1% (2 of 1372) of reports.
H314 (99.9%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
trans-3-Hexenoic acid; 1577-18-0; 3-Hexenoic acid, (3E)-; (E)-3-Hexenoic acid; trans-Hex-3-enoic acid; 3-Hexenoic acid, (E)-; FEMA No. 3170; 9B3N069EDG; NSC-26715; CHEBI:49285; RefChem:1100232; 216-417-8; (E)-hex-3-enoic acid; Hydrosorbic acid; 3-HEXENOIC ACID; (3E)-hex-3-enoic acid
CAS 1577-18-0; molecular formula C6H10O2; molecular weight 114.07 g/mol.
trans-3-Hexenoic acid, 1577-18-0, 3-Hexenoic acid, (3E)-, (E)-3-Hexenoic acid, trans-Hex-3-enoic acid, 3-Hexenoic acid, (E)-.
Documented regulatory listings: FDA Substance added to food: FLAVORING AGENT OR ADJUVANT; FLAVOURING_AGENT: Flavouring Agent; Fruit.
0.1% of GHS notifications report no hazard classification (2 of 1372).
Facts on this page are taken from PubChem (US National Library of Medicine) and Wikidata. Grade-specific data — assay, moisture, particle size, packaging, shelf life — is issued per batch on the COA and is not published here.